HRID1209167

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID13011

2-Chloroanisole

C7H7ClO

结构：CC(C)c1cccc(C(C)C)c1N1CC[NH+](c2c(C(C)C)cccc2C(C)C)C1

HCID20732211

未命名化合物

HCID178506998

未命名化合物

PRODUCTS

生成物

HCID54385117

1-(2-Methoxyphenyl)naphthalene

C17H14O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0ca6a5ca9749437d92803e5529250273
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br-:6].[CH2:1]1[O:2][CH2:3][CH2:4][CH2:5]1.[CH3:57][CH2:58][CH2:59][CH2:60][CH2:61][CH3:62].[CH3:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[CH:28]([c:29]1[cH:30][cH:31][cH:32][c:33]([CH:34]([CH3:35])[CH3:36])[c:37]1[NH+:38]1[CH2:39][CH2:40][N:41]([c:42]2[c:43]([CH:44]([CH3:45])[CH3:46])[cH:47][cH:48][cH:49][c:50]2[CH:51]([CH3:52])[CH3:53])[CH2:54]1)([CH3:55])[CH3:56].[Cl-:27].[Cl:18][c:19]1[c:20]([O:25][CH3:26])[cH:21][cH:22][cH:23][cH:24]1.[c:7]1([Mg+:17])[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12>>[c:7]1(-[c:19]2[c:20]([O:25][CH3:26])[cH:21][cH:22][cH:23][cH:24]2)[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12